58619-88-8
1,3-DIOXANE, 2-(1-METHYLETHYL)-5-NITRO-
Name1,3-DIOXANE, 2-(1-METHYLETHYL)-5-NITRO-
1Identification
【Name】
1,3-DIOXANE, 2-(1-METHYLETHYL)-5-NITRO-
【CAS】
【MDL】
MFCD00031009
【English Synonyms】
【Formula】
C7 H13 N O4
【MolWeight】
175.183
【Inchi】
InChI=1S/C7H13NO4/c1-5(2)7-11-3-6(4-12-7)8(9)10/h5-7H,3-4H2,1-2H3
【InChIKey】
InChIKey=KPDQVDPNOWIHOY-UHFFFAOYSA-N
【SMILES】
CC(C)C1OCC(CO1)[N+](=O)[O-]
【MOL File】
1,3-DIOXANE, 2-(1-ME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,3-DIOXANE, 2-(1-METHYLETHYL)-5-NITRO-.cml